UCSF

ZINC69764903

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 30th, 2011 15 No

Popular Name: 4-methyl-5-[2-(3-thienyl)ethylsulfanyl]thiazol-2-amine 4-methyl-5-[2-(3-thienyl)ethylsu…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.81 6.29 -6.4 2 2 0 39 256.421 4 ↓
Lo Low (pH 4.5-6) 2.81 6.7 -28.3 3 2 1 40 257.429 4 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.